bulk:  Si dia 5.431
subst:  Mg 1.51011430257
v1: 4325.16990576
n1: 216
v1pa: 20.0239347489
ene0: -1000.08
ene0pa: -4.63
subst n: 12
ene1nm: -993.5134
ene1nmf: 3.44671430257
ene2m: -994.07973
ene2mf: 2.88038430257
ene3v: -994.10836
ene3vf: 2.85175430257
esubf: 2.85175430257
V4: 4345.42341863
vintf:  40.2774476182
vintfr:  2.01146518521
